⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27696601 | 0.74 | — | — | |
| SCHEMBL1637783 | 0.72 | — | — | |
| SCHEMBL1980202 | 0.70 | — | — | |
| SCHEMBL3721406 | 0.70 | — | — | |
| SCHEMBL28688691 | 0.70 | — | — | |
| SCHEMBL28688692 | 0.70 | — | — | |
| SCHEMBL11434143 | 0.68 | — | — | |
| SCHEMBL4947861 | 0.67 | — | — | |
| SCHEMBL10447406 | 0.67 | — | — | |
| SCHEMBL2372415 | 0.67 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113845436-A | Method for applying o-phosphino-phenol photocatalyst to defluorination alkylation and defluorination protonation reactions | 中国科学技术大学 | 2021-12-28 | — | — | CN | claimed |
| CN-113845436-A | Method for applying o-phosphino-phenol photocatalyst to defluorination alkylation and defluorination protonation reactions | 中国科学技术大学 | 2021-12-28 | — | — | CN | disclosed |